3-methyl-4-oxidanylidene-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)phthalazine-1-carboxamide

Systemtic Name: 3-methyl-4-oxidanylidene-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)phthalazine-1-carboxamide Openeye Name: 3-methyl-4-oxo-N-[4-(3-pyridyl)thiazol-2-yl]phthalazine-1-carboxamide CAS Name: 3-methyl-4-oxo-N-[4-(3-pyridinyl)-2-thiazolyl]-1-phthalazinecarboxamide IUPAC Name: 3-methyl-4-oxo-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)phthalazine-1-carboxamide Traditional Name: 4-keto-3-methyl-N-[4-(3-pyridyl)thiazol-2-yl]phthalazine-1-carboxamide Formula: C18H13N5O2S MolecularWeight: 363.39312

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC(=CS3)C4=CN=CC=C4

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC(=CS3)C4=CN=CC=C4

InChI

InChI=1S/C18H13N5O2S/c1-23-17(25)13-7-3-2-6-12(13)15(22-23)16(24)21-18-20-14(10-26-18)11-5-4-8-19-9-11/h2-10H,1H3,(H,20,21,24)